1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-[4-(2-pyrimidyl)piperazino]-2-(2-pyrimidylthio)ethanone Formula: C14H16N6OS MolecularWeight: 316.38144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C14H16N6OS/c21-12(11-22-14-17-5-2-6-18-14)19-7-9-20(10-8-19)13-15-3-1-4-16-13/h1-6H,7-11H2